1-[3-(phenylsulfonyl)propyl]-3-(2-piperidin-1-ylethyl)-1-propan-2-yl-urea

Systemtic Name: 1-[3-(phenylsulfonyl)propyl]-3-(2-piperidin-1-ylethyl)-1-propan-2-yl-urea Openeye Name: 1-[3-(benzenesulfonyl)propyl]-1-isopropyl-3-[2-(1-piperidyl)ethyl]urea CAS Name: 1-[3-(benzenesulfonyl)propyl]-3-[2-(1-piperidinyl)ethyl]-1-propan-2-ylurea IUPAC Name: 1-[3-(benzenesulfonyl)propyl]-3-(2-piperidin-1-ylethyl)-1-propan-2-ylurea Traditional Name: 1-(3-besylpropyl)-1-isopropyl-3-(2-piperidinoethyl)urea Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCS(=O)(=O)C1=CC=CC=C1)C(=O)NCCN2CCCCC2

Isomeric SMILES

CC(C)N(CCCS(=O)(=O)C1=CC=CC=C1)C(=O)NCCN2CCCCC2

InChI

InChI=1S/C20H33N3O3S/c1-18(2)23(20(24)21-12-16-22-13-7-4-8-14-22)15-9-17-27(25,26)19-10-5-3-6-11-19/h3,5-6,10-11,18H,4,7-9,12-17H2,1-2H3,(H,21,24)